ethyl 2-[2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-1-yl)ethanoylamino]-5-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-1-yl)ethanoylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2,4-dimethyl-6-oxo-pyrimidin-1-yl)acetyl]amino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-(2,4-dimethyl-6-oxo-1-pyrimidinyl)-1-oxoethyl]amino]-5-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2,4-dimethyl-6-oxopyrimidin-1-yl)acetyl]amino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(6-keto-2,4-dimethyl-pyrimidin-1-yl)acetyl]amino]-5-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN3C(=NC(=CC3=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=O)CN3C(=NC(=CC3=O)C)C

InChI

InChI=1S/C21H21N3O4S/c1-4-28-21(27)16-11-17(15-8-6-5-7-9-15)29-20(16)23-18(25)12-24-14(3)22-13(2)10-19(24)26/h5-11H,4,12H2,1-3H3,(H,23,25)